In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 13th, 2008 | 35 | Yes |
Popular Name: BRD-A37614985-001-01-9 BRD-A37614985-001-01-9
1-[4-(2-hydroxyethyl)-1-piperazinyl]-3-(5-methyl-2,3-diphenyl-1H-indol-1-yl)-2-propanol
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.69 | 8.58 | -10.83 | 2 | 5 | 0 | 52 | 469.629 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.69 | 10.93 | -46.59 | 3 | 5 | 1 | 53 | 470.637 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.69 | 10.97 | -40.05 | 3 | 5 | 1 | 53 | 470.637 | 8 | ↓ |